3-CETC
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    WARNING: This product is for research use only, not for human or veterinary use.

MedKoo CAT#: 563637

CAS#: 117620-77-6

Description: 3-CETC is a fluorescent CYP1A1 &1A2 substrate.


Chemical Structure

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3-CETC
CAS# 117620-77-6

Theoretical Analysis

MedKoo Cat#: 563637
Name: 3-CETC
CAS#: 117620-77-6
Chemical Formula: C12H9NO3
Exact Mass: 215.0582
Molecular Weight: 215.2
Elemental Analysis: C, 66.97; H, 4.22; N, 6.51; O, 22.30

Price and Availability

Size Price Availability Quantity
5.0mg USD 220.0 2 Weeks
10.0mg USD 360.0 2 Weeks
25.0mg USD 610.0 2 Weeks
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Synonym: 3-CETC; 3 CETC; 3CETC;

IUPAC/Chemical Name: 3-Cyano-7-ethoxycoumarin

InChi Key: YAFGHMIAFYQSCF-UHFFFAOYSA-N

InChi Code: InChI=1S/C12H9NO3/c1-2-15-10-4-3-8-5-9(7-13)12(14)16-11(8)6-10/h3-6H,2H2,1H3

SMILES Code: O=C1OC2=C(C=CC(OCC)=C2)C=C1C#N

Appearance: Solid powder

Purity: >98% (or refer to the Certificate of Analysis)

Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.

Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

Solubility: Soluble in DMSO

Shelf Life: >3 years if stored properly

Drug Formulation: This drug may be formulated in DMSO

Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).

HS Tariff Code: 2934.99.03.00

Preparing Stock Solutions

The following data is based on the product molecular weight 215.2 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL

Molarity Calculator

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Reconstitution Calculator

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3-CETC

5.0mg / USD 220.0